2-Chloro-4-(methylthio)-ε-oxobenzenehexanoic acid
CAS Registry Number®
951889-94-4
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CAS Name
2-Chloro-4-(methylthio)-ε-oxobenzenehexanoic acidMolecular Formula
C13H15ClO3SMolecular Mass
286.77Cite this Page
2-Chloro-4-(methylthio)-ε-oxobenzenehexanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=951889-94-4 (retrieved ) (CAS RN: 951889-94-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C13H15ClO3S/c1-18-9-6-7-10(11(14)8-9)12(15)4-2-3-5-13(16)17/h6-8H,2-5H2,1H3,(H,16,17)
InChIKey
InChIKey=WGDRSBJOERECRL-UHFFFAOYSA-N
SMILES
C(CCCCC(O)=O)(=O)C1=C(Cl)C=C(SC)C=C1
Canonical SMILES
O=C(O)CCCCC(=O)C1=CC=C(SC)C=C1Cl
Other Names for this Substance
- Benzenehexanoic acid, 2-chloro-4-(methylthio)-ε-oxo-
- 2-Chloro-4-(methylthio)-ε-oxobenzenehexanoic acid